1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine

C14H26N2O — CID 97484526

IUPAC1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine
SMILESCN(C)C[C@]12COC[C@H]1CN(C1CCCC1)C2
InChIInChI=1S/C14H26N2O/c1-15(2)9-14-10-16(13-5-3-4-6-13)7-12(14)8-17-11-14/h12-13H,3-11H2,1-2H3/t12-,14+/m1/s1
InChIKeyNIKSBNPOQHBXIL-OCCSQVGLSA-N
MW238.37 g/mol
LogP1.44
Rot. Bonds3

About 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine

1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine (PubChem CID 97484526) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine
PubChem CID97484526
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine
SMILESCN(C)C[C@]12COC[C@H]1CN(C1CCCC1)C2
InChIInChI=1S/C14H26N2O/c1-15(2)9-14-10-16(13-5-3-4-6-13)7-12(14)8-17-11-14/h12-13H,3-11H2,1-2H3/t12-,14+/m1/s1
InChIKeyNIKSBNPOQHBXIL-OCCSQVGLSA-N
XLogP1.44
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine (CID 97484526) is 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine is CN(C)C[C@]12COC[C@H]1CN(C1CCCC1)C2.
What is the InChIKey of 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine?
The InChIKey is NIKSBNPOQHBXIL-OCCSQVGLSA-N. The full InChI is InChI=1S/C14H26N2O/c1-15(2)9-14-10-16(13-5-3-4-6-13)7-12(14)8-17-11-14/h12-13H,3-11H2,1-2H3/t12-,14+/m1/s1.
What are the key properties of 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine?
1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine has a molecular weight of 238.37 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3aR,6aR)-5-cyclopentyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 97484526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).